SCHEMBL27657331

SCHEMBL27657331

NCc1cccc(N(C(N)=O)c2ccc(-c3cc(Br)c4c(N)n[nH]c4c3)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 5/20 0.43
▸ FGFR1 P11362 2/20 0.39
▸ FGFR2 P21802 1/20 0.39
▸ FGFR3 P22607 1/20 0.39
▸ ROCK1 Q13464 3/20 0.36
▸ NTRK2 Q16620 2/20 0.36
▸ LTK P29376 1/20 0.36
▸ CDK8 P49336 1/20 0.36
▸ MAP2K1 Q02750 1/20 0.36
▸ NTRK3 Q16288 1/20 0.36
▸ ABL1 P00519 10/20 0.36
▸ BCR P11274 10/20 0.36
▸ FLT3 P36888 3/20 0.35
▸ KIT P10721 2/20 0.35
▸ PRKACA P17612 3/20 0.34
▸ CDK2 P24941 3/20 0.34
▸ JAK2 O60674 3/20 0.34
▸ PLK4 O00444 2/20 0.34
▸ AURKA O14965 2/20 0.34
▸ CDK1 P06493 2/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27636379 0.87 KDR (0.48) KDRFGFR1FGFR2FGFR3ROCK1
SCHEMBL27636557 0.86 FGFR2 (0.51) KDRFGFR1FGFR2FGFR3NTRK2
SCHEMBL27636462 0.84 KDR (0.60) KDRFGFR1ROCK1NTRK2LTK
SCHEMBL27636389 0.83 KDR (0.49) KDRFGFR1ROCK1NTRK2NTRK3
SCHEMBL27657396 0.81 KDR (0.52) KDRFGFR1FGFR2FGFR3ROCK1
SCHEMBL27636419 0.80 KDR (0.52) KDRFGFR1ROCK1NTRK2ABL1
SCHEMBL27657333 0.77 KDR (0.54) KDRFGFR1FGFR2FGFR3ROCK1
SCHEMBL27657358 0.76 KDR (0.58) KDRFGFR1ROCK1NTRK2LTK
SCHEMBL27636383 0.76 KDR (0.53) KDRFGFR1ROCK1NTRK2LTK
SCHEMBL27636373 0.75 KDR (0.62) KDRFGFR1ROCK1NTRK2LTK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1826324-B indazole, Benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LABORATORIES (US) 2011-12-07 — — CN claimed
CN-1826324-A Indazole, benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LAB (US) 2006-08-30 — — CN claimed
CN-102417487-A Indazole, benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LAB 2012-04-18 — — CN disclosed
CN-1826324-B indazole, Benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LABORATORIES (US) 2011-12-07 — — CN disclosed
CN-101827584-A Solid dispersion product of N-aryl ureido drugs ABBOTT GMBH & CO KG 2010-09-08 — — CN disclosed
CN-1826324-A Indazole, benzisoxazole and benzisothiazole kinase inhibitors ABBOTT LAB (US) 2006-08-30 — — CN disclosed
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